Lorazepam

Details

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Internal ID 270a5df9-a182-4cd6-8298-18bd2a3af198
Taxonomy Organoheterocyclic compounds > Benzodiazepines > 1,4-benzodiazepines
IUPAC Name 7-chloro-5-(2-chlorophenyl)-3-hydroxy-1,3-dihydro-1,4-benzodiazepin-2-one
SMILES (Canonical) C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)O)Cl
SMILES (Isomeric) C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)O)Cl
InChI InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)
InChI Key DIWRORZWFLOCLC-UHFFFAOYSA-N
Popularity 16,458 references in papers

Physical and Chemical Properties

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Molecular Formula C15H10Cl2N2O2
Molecular Weight 321.20 g/mol
Exact Mass 320.0119330 g/mol
Topological Polar Surface Area (TPSA) 61.70 Ų
XlogP 2.40

Synonyms

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Ativan
846-49-1
o-Chloroxazepam
o-Chlorooxazepam
Temesta
Loraz
Bonatranquan
Anxiedin
Lorabenz
Sedatival
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Lorazepam

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 95.50% 91.11%
CHEMBL4026 P40763 Signal transducer and activator of transcription 3 93.81% 82.69%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.66% 95.56%
CHEMBL3524 P56524 Histone deacetylase 4 90.06% 92.97%
CHEMBL1907600 Q00535 Cyclin-dependent kinase 5/CDK5 activator 1 89.46% 93.03%
CHEMBL1293249 Q13887 Kruppel-like factor 5 88.39% 86.33%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 87.69% 94.00%
CHEMBL3401 O75469 Pregnane X receptor 87.37% 94.73%
CHEMBL1937 Q92769 Histone deacetylase 2 86.90% 94.75%
CHEMBL218 P21554 Cannabinoid CB1 receptor 85.83% 96.61%
CHEMBL2335 P42785 Lysosomal Pro-X carboxypeptidase 85.83% 100.00%
CHEMBL2820 P03951 Coagulation factor XI 83.55% 95.29%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 82.69% 94.62%
CHEMBL2581 P07339 Cathepsin D 82.59% 98.95%
CHEMBL4530 P00488 Coagulation factor XIII 80.18% 96.00%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Triticum aestivum

Cross-Links

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PubChem 3958
LOTUS LTS0115481
wikiData Q408265